SCHEMBL15099684

SCHEMBL15099684

CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2c(Br)cccc2c1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16657253 0.91 MAPT (0.33) MAPTHTTSMN1; SMN2HSD17B10
SCHEMBL16657251 0.90 GAA (0.31) MAPT
SCHEMBL15093213 0.90 PSIP1 (0.32)
SCHEMBL1699706 0.85 HSD17B10 (0.35) MAPTHTTSMN1; SMN2HSD17B10
SCHEMBL10271716 0.85 HSD17B10 (0.35) MAPTHTTSMN1; SMN2HSD17B10
SCHEMBL15099754 0.84 HTT (0.38) MAPTHTTSMN1; SMN2HSD17B10
SCHEMBL1699726 0.83 MAPT (0.35) MAPTHTTSMN1; SMN2HSD17B10
SCHEMBL15165315 0.83 MAPT (0.35) MAPTHTTSMN1; SMN2HSD17B10
SCHEMBL15093279 0.83 SMN1; SMN2 (0.34) MAPTHTTSMN1; SMN2HSD17B10
SCHEMBL15099650 0.83 SMN1; SMN2 (0.34) MAPTHTTSMN1; SMN2HSD17B10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9284323-B2 Naphthalene acetic acid derivatives against HIV infection GILEAD SCIENCES, INC. (US) 2016-03-15 US disclosed
US-20150111891-A1 NAPHTHALENE ACETIC ACID DERIVATIVES AGAINST HIV INFECTION GILEAD SCIENCES, INC. (US) 2015-04-23 US disclosed
US-20150111891-A1 NAPHTHALENE ACETIC ACID DERIVATIVES AGAINST HIV INFECTION GILEAD SCIENCES, INC. (US) 2015-04-23 US disclosed
WO-2013103738-A1 NAPTHALENE ACETIC ACID DERIVATIVES AGAINST HIV INFECTION GILEAD SCIENCES, INC. (US) 2013-07-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150111891-A1 NAPHTHALENE ACETIC ACID DERIVATIVES AGAINST HIV INFECTION NFATC1, ACIN1, NAAA MAPT 671/4885HTT 1606/4885SMN1; SMN2 2614/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.